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Sugi Predict / Compounds / SCHEMBL7003550

SCHEMBL7003550

SCHEMBL7003550

CN1CCC(CC(=O)N2CCC(=C3c4ccc(Cl)cc4SCc4cccnc43)CC2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 11/20 1.00
▸ FNTB P49356 11/20 1.00
▸ SLC6A15 Q9H2J7 10/20 0.66
▸ HRH1 P35367 6/20 0.66
▸ PTAFR P25105 3/20 0.57

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7002862 0.92 FNTA (1.00) FNTAFNTBSLC6A15HRH1PTAFR
SCHEMBL6993307 0.91 FNTA (1.00) FNTAFNTBSLC6A15HRH1PTAFR
SCHEMBL6997676 0.89 FNTA (0.81) FNTAFNTBSLC6A15HRH1PTAFR
SCHEMBL8127745 0.88 FNTA (0.78) FNTAFNTBSLC6A15HRH1PTAFR
SCHEMBL6989397 0.85 FNTA (0.79) FNTAFNTBSLC6A15HRH1PTAFR
SCHEMBL9374487 0.84 PTAFR (0.73) FNTAFNTBSLC6A15HRH1PTAFR
SCHEMBL6996008 0.84 FNTA (0.71) FNTAFNTBSLC6A15HRH1PTAFR
SCHEMBL6999519 0.83 FNTA (0.69) FNTAFNTBSLC6A15HRH1PTAFR
SCHEMBL6993193 0.82 FNTA (0.79) FNTAFNTBSLC6A15HRH1PTAFR
SCHEMBL6991647 0.82 FNTA (1.00) FNTAFNTBSLC6A15

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1021448-B1 TRICYCLIC COMPOUNDS HAVING ACTIVITY AS Ras-FPT INHIBITORS SCHERING CORP (US) 2003-05-02 — — EP disclosed
US-6130229-A Tricyclic compounds having activity as RAS-FPT inhibitors SCHERING CORPORATION (US) 2000-10-10 — — US disclosed